CID 11507417

882660-40-4

Structural Information

Molecular Formula
C16H29N3O
SMILES
CC(=O)NC1CCC(CC1)N2CCN(CC2)CC3CC3
InChI
InChI=1S/C16H29N3O/c1-13(20)17-15-4-6-16(7-5-15)19-10-8-18(9-11-19)12-14-2-3-14/h14-16H,2-12H2,1H3,(H,17,20)
InChIKey
RKDOUGDECLHTQZ-UHFFFAOYSA-N
Compound name
N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

279.23105 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.23833 173.4
[M+Na]+ 302.22027 176.2
[M-H]- 278.22377 178.7
[M+NH4]+ 297.26487 181.1
[M+K]+ 318.19421 172.1
[M+H-H2O]+ 262.22831 163.6
[M+HCOO]- 324.22925 187.0
[M+CH3COO]- 338.24490 205.1
[M+Na-2H]- 300.20572 172.4
[M]+ 279.23050 167.1
[M]- 279.23160 167.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe